ML NHYP: Difference between revisions
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== Related Tags and Sections == | == Related Tags and Sections == | ||
{{TAG|ML_FF_RCUT1_MB}}, {{TAG|ML_FF_SION1_MB}} | {{TAG|ML_FF_RCUT1_MB}}, {{TAG|ML_FF_SION1_MB}} | ||
{{sc|ML_FF_NHYP1_MB|Examples|Examples that use this tag}} | {{sc|ML_FF_NHYP1_MB|Examples|Examples that use this tag}} | ||
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[[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]] | [[Category:INCAR]][[Category:Machine Learning]][[Category:Machine Learned Force Fields]][[Category: Alpha]] | ||
Revision as of 07:24, 7 June 2021
ML_FF_NHYP1_MB = [inter]
Default: ML_FF_NHYP1_MB = 4
Description: Polynomial power of the kernel.
This tag specifies the power [math]\displaystyle{ \zeta }[/math] of the polynomial kernel
[math]\displaystyle{ K \left(\mathbf{X}_{i},\mathbf{X}_{i_\mathrm{B}}\right) = \left[ \beta \mathbf{X}_{i}^{(2)} \cdot \mathbf{X}_{i_{\mathrm{B}}}^{(2)} + (1-\beta) \mathbf{\hat{X}}_{i}^{(3)} \cdot \mathbf{\hat{X}}_{i_{\mathrm{B}}}^{(3)} \right]^{\zeta}. }[/math]
Related Tags and Sections
ML_FF_RCUT1_MB, ML_FF_SION1_MB